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  1. Third-Parties
  2. MatprojStructure
  3. mp-1220842

Entry Data

Table mix-ins: ['Structure', 'Thermodynamics'] Extra columns: ['energy_uncorrected', 'band_gap', 'is_gap_direct', 'is_magnetic', 'total_magnetization', 'is_theoretical']

Base Information:

  • Database Entry ID: mp-1220842
  • Created at: Sept. 4, 2022, 2:42 p.m.
  • Last updated at: Nov. 28, 2021, 1:35 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 80
  • Number of elements: 4
  • Element list: ['Nd', 'Y', 'Fe', 'O']
  • Chemical System: Fe-Nd-O-Y
  • Density: 5.359832049240986
  • Atomic Density: 0.07863590462585007
  • Unit Cell Volume: 1017.3469788468805
  • Molar Volume: 7.658258385470821
  • Full Formula: Nd6 Y6 Fe20 O48
  • Reduced Formula: Nd3Y3(Fe5O12)2
  • Formula Anonymous: A3B3C10D24
  • Spacegroup Number: 214
  • Spacegroup Symbol: I4_132
  • Crystal System: cubic
  • Pointgroup: 432

Thermodynamics:

  • Final energy: -675.30440544
  • Final energy per atom: -8.441305068
  • Energy above hull: None
  • Is thermodynamically stable?: None
  • Decomposes to: None
  • Formation energy None
  • Formation energy per atom: None
Note: stabilities and hull energies are updated on a running schedule, so newer materials may have these fields blank.